SCHEMBL8296805

SCHEMBL8296805

CCCn1c(=O)c(=O)[nH]c2cc([N+](=O)[O-])c(-n3ccc(=O)cc3)cc21

nearest known ligand 0.73

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 6/20 0.63
GRIK2 Q13002 6/20 0.63
GRIK5 Q16478 5/20 0.63
GRIK3 Q13003 4/20 0.63
GRIK4 Q16099 4/20 0.63
GRIA1 P42261 4/20 0.60
GRIA2 P42262 4/20 0.60
GRIA3 P42263 4/20 0.60
GRIA4 P48058 4/20 0.60

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8290910 0.89 GRIK1 (0.59) GRIK1GRIK2GRIK5GRIK3GRIK4
Hydrochloric Acid SCHEMBL8129889 0.83 SLC22A6 (0.72) GRIK1GRIK2GRIK5GRIK3GRIK4
SCHEMBL8609604 0.82 GRIK1 (0.78) GRIK1GRIK2GRIK5GRIK3GRIK4
Sulfuric Acid SCHEMBL8200151 0.80 SLC22A6 (0.70) GRIK1GRIK2GRIK5GRIK3GRIK4
SCHEMBL8292029 0.79 GRIK1 (0.50) GRIK1GRIK2GRIK5GRIK3GRIK4
SCHEMBL8609255 0.78 GRIK1 (0.69) GRIK1GRIK2GRIK5GRIK3GRIK4
SCHEMBL8613051 0.77 GRIK1 (0.71) GRIK1GRIK2GRIK5GRIK3GRIK4
SCHEMBL8291676 0.77 GRIA1 (0.78) GRIK1GRIK2GRIK5GRIK3GRIK4
Hydrochloric Acid SCHEMBL8129882 0.76 SLC22A6 (0.68) GRIK1GRIK2GRIK5GRIK3GRIK4
Sulfuric Acid SCHEMBL8192619 0.75 SLC22A6 (0.68) GRIK1GRIK2GRIK5GRIK3GRIK4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0676397-B1 Oxopyridinylquinoxaline derivatives SHIONOGI & CO (JP) 1999-10-20 EP disclosed
US-5677305-A NERVOUS SYSTEM DISORDERS SHIONOGI & CO., LTD. (JP) 1997-10-14 US disclosed
EP-0676397-A1 Oxopyridinylquinoxaline derivatives SHIONOGI & CO., LTD. (JP) 1995-10-11 EP disclosed